Geometry & MOs

Info

ID:	9618
PubChem CID:	91576
Reduced:	O6C7H14 (1)
Stoich.:	A6B7C14 (1)
Weight, g/mol:	194.079038
ΔH_f, kcal/mol:	-275.51
Dipole, Da:	1.54
IP(EA), eV:	-10.5(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,5R)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol

Drug info:

PubChemData

Smile

COC1[C@@H](C([C@@H](C(O1)CO)O)O)O

DOS

IR

Vibrations